Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 6/20 | 0.33 |
| ▸ | ABL1 | P00519 | 5/20 | 0.33 |
| ▸ | ABL2 | P42684 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PRKCA | P17252 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1921411 | 0.78 | AHR (0.50) | AHRSMN1; SMN2HTR2AHTR2CMAPT | |
| SCHEMBL4028988 | 0.75 | AHR (0.47) | AHRSMN1; SMN2HTR2AHTR2CCYP3A4 | |
| SCHEMBL22609023 | 0.75 | AHR (0.52) | AHRSMN1; SMN2HTR2AHTR2CMAPT | |
| SCHEMBL933915 | 0.75 | HTR2A (0.54) | AHRSMN1; SMN2HTR2AHTR2CMAPT | |
| SCHEMBL29782575 | 0.75 | AHR (0.52) | AHRSMN1; SMN2HTR2AHTR2CMAPT | |
| Hydrochloric Acid SCHEMBL28459539 | 0.73 | AHR (0.45) | AHRSMN1; SMN2HTR2AHTR2CPTGS1 | |
| Hydrochloric Acid SCHEMBL28465976 | 0.73 | AHR (0.45) | AHRSMN1; SMN2HTR2AHTR2CPTGS1 | |
| SCHEMBL3188879 | 0.72 | AHR (0.44) | AHRSMN1; SMN2HTR2AHTR2CMAPT | |
| Potassium SCHEMBL3627554 | 0.72 | AHR (0.48) | AHRSMN1; SMN2HTR2AHTR2CMAPT | |
| SCHEMBL8762464 | 0.72 | KDM4E (0.56) | AHRSMN1; SMN2HTR2AHTR2CPTGS1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020057403-A1 | INDOLE DERIVATIVE AND MEDICAL APPLICATION THEREOF | 北京越之康泰生物医药科技有限公司 | 2020-03-26 | — | — | WO | disclosed |